# generated using pymatgen
data_Ba6Zn(IrO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.18942009
_cell_length_b   9.18942032
_cell_length_c   7.22353426
_cell_angle_alpha   67.62588938
_cell_angle_beta   67.62588993
_cell_angle_gamma   36.77912335
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba6Zn(IrO6)2
_chemical_formula_sum   'Ba6 Zn1 Ir2 O12'
_cell_volume   334.55095524
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  1  0.21002942  0.21002942  0.71055727  1.0
  Ba  Ba1  1  0.88617376  0.88617376  0.70710445  1.0
  Ba  Ba2  1  0.54720314  0.54720314  0.71793156  1.0
  Ba  Ba3  1  0.78997058  0.78997058  0.28944273  1.0
  Ba  Ba4  1  0.45279686  0.45279686  0.28206844  1.0
  Ba  Ba5  1  0.11382624  0.11382624  0.29289555  1.0
  Zn  Zn6  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir7  1  0.66941284  0.66941284  0.00100747  1.0
  Ir  Ir8  1  0.33058716  0.33058716  0.99899253  1.0
  O  O9  1  0.27968890  0.27968890  0.30551074  1.0
  O  O10  1  0.94977771  0.94977771  0.30261466  1.0
  O  O11  1  0.61820264  0.61820264  0.30752712  1.0
  O  O12  1  0.72031110  0.72031110  0.69448926  1.0
  O  O13  1  0.38179736  0.38179736  0.69247288  1.0
  O  O14  1  0.05022229  0.05022229  0.69738534  1.0
  O  O15  1  0.00000000  0.50000000  0.00000000  1.0
  O  O16  1  0.64340378  0.17582491  0.99999027  1.0
  O  O17  1  0.35659622  0.82417509  0.00000973  1.0
  O  O18  1  0.50000000  0.00000000  0.00000000  1.0
  O  O19  1  0.17582491  0.64340378  0.99999027  1.0
  O  O20  1  0.82417509  0.35659622  0.00000973  1.0